SCHEMBL25429548

SCHEMBL25429548

Cc1nc2cccc(CCCCCCCCN3CCN(C)CC3)c2c(=O)n1C1CCC(C(=O)C=O)NC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.34
HTR7 P34969 3/20 0.33
MCHR1 Q99705 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
TNF P01375 1/20 0.31
IL1B P01584 1/20 0.31
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
IKZF3 Q9UKT9 1/20 0.31
MC4R P32245 3/20 0.31
KCNH2 Q12809 2/20 0.31
HRH3 Q9Y5N1 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
SLC6A4 P31645 1/20 0.31
CCR5 P51681 4/20 0.31
HTR3A P46098 1/20 0.31
CCNE2 O96020 1/20 0.31
CDK4 P11802 1/20 0.31
PRKACA P17612 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25430058 1.00 HTR1A (0.34) HTR1AHTR7MCHR1SIGMAR1TNF
SCHEMBL25346369 0.89 TNF (0.34) TNFIL1BDDB1CRBNIKZF3
SCHEMBL28030943 0.83 DDB1 (0.38) TNFIL1BDDB1CRBNIKZF3
SCHEMBL25433270 0.82 LMNA (0.33) TNFIL1BDDB1CRBNIKZF3
SCHEMBL25346279 0.81 SIGMAR1 (0.41) HTR1AHTR7SIGMAR1MC4RKCNH2
SCHEMBL25345447 0.81 SIGMAR1 (0.41) HTR1AHTR7SIGMAR1MC4RKCNH2
SCHEMBL28030946 0.80 DDB1 (0.39) TNFIL1BDDB1CRBNIKZF3
SCHEMBL25346645 0.78 PIK3CD (0.35) KCNH2HRH3
SCHEMBL28822138 0.78 HRH3 (0.39) TNFIL1BDDB1CRBNIKZF3
SCHEMBL27936623 0.78 DDB1 (0.51) TNFIL1BDDB1CRBNIKZF3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023151635-A1 COMPOUND BASED ON QUINAZOLINE-SUBSTITUTED GLUTARIMIDE SKELETON AND USE THEREOF 标新生物医药科技(上海)有限公司 2023-08-17 WO claimed